4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl 2,6-difluorobenzoate

SpectraBase Compound ID	3jMBQdvorWR
InChI	InChI=1S/C21H14F2N4O3/c1-10-16-17(13(9-24)19(25)30-20(16)27-26-10)11-5-7-12(8-6-11)29-21(28)18-14(22)3-2-4-15(18)23/h2-8,17H,25H2,1H3,(H,26,27)
InChIKey	VIBUDBAWEBPQAR-UHFFFAOYSA-N Google Search
Mol Weight	408.36 g/mol
Molecular Formula	C21H14F2N4O3
Exact Mass	408.103397 g/mol

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SpectraBase Spectrum ID	4SBeDnAr2TT
Name	4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl 2,6-difluorobenzoate
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H14F2N4O3/c1-10-16-17(13(9-24)19(25)30-20(16)27-26-10)11-5-7-12(8-6-11)29-21(28)18-14(22)3-2-4-15(18)23/h2-8,17H,25H2,1H3,(H,26,27)
InChIKey	VIBUDBAWEBPQAR-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_2057
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: NMR/9311380; Labnumber: VUR-0000822